acetyloxymethyl (2Z)-3-[(6-chloranylpyridin-3-yl)methyl]-2-nitroimino-imidazolidine-1-carboxylate

Systemtic Name: acetyloxymethyl (2Z)-3-[(6-chloranylpyridin-3-yl)methyl]-2-nitroimino-imidazolidine-1-carboxylate Openeye Name: acetoxymethyl (2Z)-3-[(6-chloro-3-pyridyl)methyl]-2-nitroimino-imidazolidine-1-carboxylate CAS Name: (2Z)-3-[(6-chloro-3-pyridinyl)methyl]-2-nitroimino-1-imidazolidinecarboxylic acid acetyloxymethyl ester IUPAC Name: acetyloxymethyl (2Z)-3-[(6-chloropyridin-3-yl)methyl]-2-nitroiminoimidazolidine-1-carboxylate Traditional Name: (2Z)-3-[(6-chloro-3-pyridyl)methyl]-2-nitroimino-imidazolidine-1-carboxylic acid acetoxymethyl ester Formula: C13H14ClN5O6 MolecularWeight: 371.73316

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCOC(=O)N1CCN(C1=N[N+](=O)[O-])CC2=CN=C(C=C2)Cl

Isomeric SMILES

CC(=O)OCOC(=O)N\1CCN(/C1=N/[N+](=O)[O-])CC2=CN=C(C=C2)Cl

InChI

InChI=1S/C13H14ClN5O6/c1-9(20)24-8-25-13(21)18-5-4-17(12(18)16-19(22)23)7-10-2-3-11(14)15-6-10/h2-3,6H,4-5,7-8H2,1H3/b16-12-